Configuration Set

ORCA__CS_3scrgs9ecuz3_0



Name ORCA
Extended ID ORCA__CS_3scrgs9ecuz3_0
Description Configurations from the mbGDML set predicted using ORCA
Elements C (17.09%)
H (61.54%)
N (5.13%)
O (16.24%)
Number of Configurations 12,503
Number of Atoms 351,090
Configurations
Datasets DS_e94my2wrh074_0
ColabFit ID CS_3scrgs9ecuz3_0
Files colabfitspec.json

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